SCHEMBL5714754

SCHEMBL5714754

CC1(C)CC(=O)N(CCc2ccc(OC(=O)N3CCN(CCCc4ccc(C(=O)O)cn4)CC3)cc2)C(=O)C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.41
HTR2A P28223 2/20 0.41
SIGMAR1 Q99720 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
HTR7 P34969 1/20 0.41
OPRM1 P35372 1/20 0.41
FAAH O00519 4/20 0.39
HTR1A P08908 2/20 0.38
THRB P10828 1/20 0.38
MGLL Q99685 1/20 0.38
HRH1 P35367 3/20 0.37
KCNH2 Q12809 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
HRH2 P25021 2/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5714251 0.93 MGLL (0.39) FAAHMGLLHRH3
SCHEMBL5714385 0.92 HTR1A (0.37) DRD2HTR2ASIGMAR1ADORA3HTR7
SCHEMBL5715394 0.90 HTR2A (0.40) DRD2HTR2ASIGMAR1ADORA3HTR7
SCHEMBL5714503 0.86 HTR2A (0.46) DRD2HTR2ASIGMAR1ADORA3HTR7
SCHEMBL5715625 0.85 THRB (0.38) HTR1ATHRBMGLL
SCHEMBL5714442 0.85 PANK3 (0.42) HTR1AHRH3
SCHEMBL5714476 0.84 HRH3 (0.36) DRD2HTR2AFAAHHTR1AHRH3
SCHEMBL5714936 0.83 DRD2 (0.45) DRD2HTR2ASIGMAR1ADORA3HTR7
SCHEMBL5714963 0.82 FAAH (0.36) DRD2HTR2ASIGMAR1ADORA3HTR7
SCHEMBL5714391 0.82 HTR1A (0.38) DRD2HTR2ASIGMAR1ADORA3HTR7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006527212-A 2006-11-30 JP claimed
US-20060160820-A1 Substituted piperazine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US claimed
EP-1636187-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2006-03-22 EP claimed
WO-2004111004-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-12-23 WO claimed
US-20060160820-A1 Substituted piperazine carbamates NOVO NORDISK A/S (DK) 2006-07-20 US disclosed
EP-1636187-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2006-03-22 EP disclosed
WO-2004111004-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-12-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060160820-A1 Substituted piperazine carbamates LIPE, PNLIP, LPL DRD2 3721/4885HTR2A 1618/4885SIGMAR1 2726/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.